SCHEMBL18879187

SCHEMBL18879187

COC(=O)c1ccc(C(=O)Nc2ccc3c(c2)OCc2cnccc2-3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 16/20 1.00
▸ AAK1 Q2M2I8 4/20 0.71

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17783758 0.92 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783763 0.91 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783821 0.88 ROCK2 (0.85) ROCK2AAK1
SCHEMBL17783817 0.87 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783799 0.87 ROCK2 (1.00) ROCK2
SCHEMBL17783814 0.86 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783796 0.86 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783768 0.85 ROCK2 (1.00) ROCK2AAK1
SCHEMBL17783802 0.85 ROCK2 (1.00) ROCK2
SCHEMBL17783798 0.84 ROCK2 (1.00) ROCK2AAK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3016950-B1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-07 — — EP claimed
US-9663529-B2 Tricyclic pyrido-carboxamide derivatives as rock inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 — — US claimed
EP-3016950-B1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-07 — — EP disclosed
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